الاسم: XIII
SMILES:
Cc1cc(C)nc(NCCCCCNCCC#N)n1Molecular Processing
Molecular formula
C14H23N5
Molecular weight
261.37
Exact mass
261.1953
XLogP
2.18
TPSA
73.63
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.643
Molar refractivity
76.95
Supplementary Information
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